data_2rna_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2rna _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 169' ' ' GLY . . . . . 0.452 ' O ' ' OG ' ' A' ' 170' ' ' SER . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.256 -1.538 . . . . 4.89 109.256 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 169' ' ' GLY . 3.2 m 177.72 59.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 4.44 110.393 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . 0.802 ' O ' ' N ' ' A' ' 173' ' ' GLU . 74.5 Cg_endo -74.44 112.66 3.6 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.106 1.871 . . . . 2.82 109.137 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 171' ' ' PRO . 43.3 mt-10 12.47 -58.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.936 1.398 . . . . 2.91 113.267 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' GLU . . . . . 0.802 ' N ' ' O ' ' A' ' 171' ' ' PRO . 40.4 mt-10 -66.66 147.64 52.99 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.71 -0.478 . . . . 1.78 109.71 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 3.4 t -162.42 -170.98 2.61 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.864 -0.334 . . . . 1.08 110.393 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 1.2 mt -116.47 153.39 32.21 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.07 0.462 . . . . 1.54 110.91 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 15.3 m -131.41 159.1 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.391 0 CA-C-N 115.647 -0.706 . . . . 1.07 109.602 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . . . . . . . . . 69.6 mt -123.97 128.07 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 108.952 -0.758 . . . . 1.1 108.952 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -80.26 114.58 19.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 1.02 110.18 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.46 -42.32 98.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 1.08 111.326 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -121.04 155.05 35.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.292 0.568 . . . . 2.27 111.719 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -73.64 97.3 2.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.41 -0.814 . . . . 2.3 110.155 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -104.54 111.87 24.71 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.188 0.518 . . . . 2.38 111.229 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.545 ' NE2' ' O ' ' A' ' 184' ' ' THR . 36.2 tp60 -98.03 140.25 32.63 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.362 -0.836 . . . . 3.01 109.337 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' THR . . . . . 0.6 HG21 ' H ' ' A' ' 186' ' ' ASP . 0.4 OUTLIER -117.91 172.07 7.64 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 121.05 0.452 . . . . 2.98 111.613 -178.202 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' ASN . . . . . 0.414 ' C ' ' OD1' ' A' ' 186' ' ' ASP . 62.7 m-20 -130.21 19.73 5.36 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.433 -0.348 . . . . 4.31 111.477 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ASP . . . . . 0.6 ' H ' HG21 ' A' ' 184' ' ' THR . 7.2 m-20 -136.91 150.31 69.32 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 122.483 -0.136 . . . . 2.47 110.806 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -72.6 -6.12 18.44 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.618 2.212 . . . . 2.35 111.547 178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -83.95 -35.54 23.91 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.228 -0.442 . . . . 3.13 110.082 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.36 151.79 19.54 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.617 -0.883 . . . . 3.13 108.617 178.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 26.2 tp -106.62 129.89 54.46 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 110.065 -0.346 . . . . 1.13 110.065 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -61.34 132.26 52.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.358 -0.608 . . . . 1.2 109.358 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' LEU . . . . . . . . . . . . . 41.5 mt -116.36 148.56 40.49 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.278 -0.419 . . . . 1.06 110.444 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.38 145.84 48.45 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.757 -0.46 . . . . 3.48 109.757 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' CYS . . . . . 0.432 ' O ' ' CB ' ' A' ' 195' ' ' ASP . 4.2 t -65.31 133.08 50.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.052 -0.522 . . . . 1.88 110.136 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 194' ' ' CYS . 1.2 t0 80.51 -15.46 0.74 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.933 -0.576 . . . . 1.95 111.034 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.5 tp10 -81.35 156.35 25.52 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 109.971 -0.381 . . . . 2.01 109.971 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.72 166.89 14.78 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.096 -0.502 . . . . 1.27 111.103 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -144.42 167.03 23.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.243 0.544 . . . . 2.17 111.796 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.56 121.66 28.58 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.269 -0.878 . . . . 2.23 109.227 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 21.0 tp -87.47 128.28 35.23 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.702 0.287 . . . . 1.73 110.308 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.81 -62.15 1.37 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.33 -0.395 . . . . 1.35 111.646 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -102.63 103.83 14.15 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.605 0.24 . . . . 1.88 111.189 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 6.1 p -106.57 -19.03 13.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.894 0.702 . . . . 1.28 112.894 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' SER . . . . . 0.496 ' O ' ' O ' ' A' ' 205' ' ' GLU . 9.4 t -64.07 -24.53 67.74 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.912 0.863 . . . . 2.75 110.876 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' GLU . . . . . 0.718 ' CG ' ' N ' ' A' ' 206' ' ' ILE . 29.4 tt0 -19.01 171.22 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 118.979 2.955 . . . . 5.9 118.979 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ILE . . . . . 0.718 ' N ' ' CG ' ' A' ' 205' ' ' GLU . 13.3 mm -147.53 -26.24 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 110.482 -3.054 . . . . 3.68 106.441 177.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' HIS . . . . . 0.456 ' H ' ' HG3' ' A' ' 205' ' ' GLU . 3.9 m-70 -100.27 -88.41 0.35 Allowed 'General case' 0 CA--C 1.56 1.335 0 N-CA-C 115.217 1.562 . . . . 2.63 115.217 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' TRP . . . . . 0.591 ' C ' ' OE1' ' A' ' 205' ' ' GLU . 90.6 m95 -128.4 120.06 26.2 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.34 0.867 . . . . 0.92 113.34 -175.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' TRP . . . . . 0.42 ' N ' ' OE2' ' A' ' 205' ' ' GLU . 1.4 m0 -70.46 124.28 23.82 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.724 0.773 . . . . 0.39 111.02 -177.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -83.14 138.8 33.51 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.39 -1.277 . . . . 3.25 109.511 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 13.4 m -134.99 155.12 37.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.788 -0.642 . . . . 1.11 109.415 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -135.16 132.86 38.51 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.013 0.435 . . . . 1.29 110.707 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -87.81 153.75 21.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.687 -0.688 . . . . 1.21 110.492 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . 0.483 ' N ' ' CD ' ' A' ' 214' ' ' LYS . 2.1 mptp? -60.93 -8.28 3.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.761 -0.654 . . . . 2.3 110.164 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -92.6 -1.23 57.06 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.041 -0.527 . . . . 1.83 111.18 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' GLY . . . . . . . . . . . . . . . 89.61 14.26 60.07 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 121.199 -0.524 . . . . 0.47 112.075 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 -95.7 133.44 39.79 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.536 -0.542 . . . . 2.24 109.536 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -131.17 150.94 51.93 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.09 0.472 . . . . 1.81 111.266 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 178.78 174.83 45.33 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 110.641 -0.983 . . . . 0.32 110.641 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -76.48 152.24 36.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.835 0.35 . . . . 2.22 110.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -146.32 122.28 5.66 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.055 -0.52 . . . . 1.06 110.802 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -50.99 123.1 11.11 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 121.068 1.179 . . . . 0.47 110.83 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 223' ' ' SER . . . . . . . . . . . . . 78.3 p -70.88 -20.09 62.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.38 -0.528 . . . . 1.46 110.674 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 46.2 m -72.65 -31.89 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.814 -0.63 . . . . 1.95 111.943 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 225' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -88.95 16.79 6.45 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.033 0.383 . . . . 2.19 112.033 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 3.0 pp -145.05 -177.05 5.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.822 0.344 . . . . 1.07 110.09 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.75 149.89 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.114 -0.494 . . . . 1.89 109.764 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 228' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.27 124.59 24.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.237 -0.438 . . . . 1.42 111.72 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 229' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 230' ' ' SER . 86.8 tttt -81.05 -38.98 26.48 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.987 -0.745 . . . . 1.93 108.987 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 230' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 229' ' ' LYS . 8.3 t 48.46 106.35 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.466 0 CA-C-N 115.43 -0.805 . . . . 1.99 110.811 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 231' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.2 139.95 52.04 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.139 1.085 . . . . 3.31 110.735 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 232' ' ' ASN . . . . . . . . . . . . . 33.2 p-10 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 117.824 -1.084 . . . . 5.04 110.906 -178.806 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.256 -1.538 . . . . 4.56 109.256 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 3.2 m 177.72 59.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 4.08 110.393 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' PRO . . . . . 0.802 ' O ' ' N ' ' A' ' 173' ' ' GLU . 74.5 Cg_endo -74.44 112.66 3.6 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.106 1.871 . . . . 2.37 109.137 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 171' ' ' PRO . 43.3 mt-10 12.47 -58.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.936 1.398 . . . . 2.91 113.267 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 173' ' ' GLU . . . . . 0.802 ' N ' ' O ' ' A' ' 171' ' ' PRO . 40.4 mt-10 -66.66 147.64 52.99 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.71 -0.478 . . . . 1.78 109.71 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 3.4 t -162.42 -170.98 2.61 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.864 -0.334 . . . . 0.6 110.393 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 1.2 mt -116.47 153.39 32.21 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.07 0.462 . . . . 0.87 110.91 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 15.3 m -131.41 159.1 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.391 0 CA-C-N 115.647 -0.706 . . . . 0.23 109.602 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ILE . . . . . . . . . . . . . 69.6 mt -123.97 128.07 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 108.952 -0.758 . . . . 0.31 108.952 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -80.26 114.58 19.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 0.19 110.18 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.46 -42.32 98.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.31 111.326 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -121.04 155.05 35.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.292 0.568 . . . . 1.36 111.719 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -73.64 97.3 2.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.41 -0.814 . . . . 2.3 110.155 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -104.54 111.87 24.71 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.188 0.518 . . . . 1.46 111.229 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -98.03 140.25 32.63 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.362 -0.836 . . . . 2.87 109.337 179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' THR . . . . . 0.836 HG23 ' H ' ' A' ' 186' ' ' ASP . 0.4 OUTLIER -117.91 172.07 7.64 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 121.05 0.452 . . . . 2.52 111.613 -178.202 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 185' ' ' ASN . . . . . 0.473 ' N ' HG23 ' A' ' 184' ' ' THR . 62.7 m-20 -130.21 19.73 5.36 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.433 -0.348 . . . . 3.85 111.477 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ASP . . . . . 0.836 ' H ' HG23 ' A' ' 184' ' ' THR . 7.2 m-20 -136.91 150.31 69.32 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 122.483 -0.136 . . . . 2.47 110.806 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -72.6 -6.12 18.44 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.618 2.212 . . . . 1.93 111.547 178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -83.95 -35.54 23.91 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.228 -0.442 . . . . 2.61 110.082 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' GLU . . . . . 0.471 ' CB ' HG21 ' A' ' 184' ' ' THR . 0.6 OUTLIER -93.36 151.79 19.54 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.617 -0.883 . . . . 3.13 108.617 178.326 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 26.2 tp -106.62 129.89 54.46 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 110.065 -0.346 . . . . 0.99 110.065 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -61.34 132.26 52.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.358 -0.608 . . . . 0.49 109.358 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' LEU . . . . . . . . . . . . . 41.5 mt -116.36 148.56 40.49 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.278 -0.419 . . . . 0.38 110.444 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 193' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.38 145.84 48.45 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.757 -0.46 . . . . 2.93 109.757 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' CYS . . . . . 0.432 ' O ' ' CB ' ' A' ' 195' ' ' ASP . 4.2 t -65.31 133.08 50.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.052 -0.522 . . . . 1.3 110.136 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 194' ' ' CYS . 1.2 t0 80.51 -15.46 0.74 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.933 -0.576 . . . . 1.95 111.034 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.5 tp10 -81.35 156.35 25.52 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 109.971 -0.381 . . . . 2.01 109.971 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.72 166.89 14.78 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.096 -0.502 . . . . 1.27 111.103 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -144.42 167.03 23.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.243 0.544 . . . . 1.24 111.796 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.56 121.66 28.58 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.269 -0.878 . . . . 1.3 109.227 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 21.0 tp -87.47 128.28 35.23 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.702 0.287 . . . . 1.13 110.308 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.81 -62.15 1.37 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.59 111.646 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -102.63 103.83 14.15 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.605 0.24 . . . . 1.88 111.189 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 6.1 p -106.57 -19.03 13.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.894 0.702 . . . . 1.28 112.894 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' SER . . . . . 0.496 ' O ' ' O ' ' A' ' 205' ' ' GLU . 9.4 t -64.07 -24.53 67.74 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.912 0.863 . . . . 2.4 110.876 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 205' ' ' GLU . . . . . 0.718 ' CG ' ' N ' ' A' ' 206' ' ' ILE . 29.4 tt0 -19.01 171.22 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 118.979 2.955 . . . . 5.9 118.979 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ILE . . . . . 0.718 ' N ' ' CG ' ' A' ' 205' ' ' GLU . 13.3 mm -147.53 -26.24 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 110.482 -3.054 . . . . 3.3 106.441 177.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 207' ' ' HIS . . . . . 0.552 ' H ' ' HG3' ' A' ' 205' ' ' GLU . 3.9 m-70 -100.27 -88.41 0.35 Allowed 'General case' 0 CA--C 1.56 1.335 0 N-CA-C 115.217 1.562 . . . . 2.19 115.217 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 208' ' ' TRP . . . . . 0.591 ' C ' ' OE1' ' A' ' 205' ' ' GLU . 90.6 m95 -128.4 120.06 26.2 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.34 0.867 . . . . 0.78 113.34 -175.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 209' ' ' TRP . . . . . 0.42 ' N ' ' OE2' ' A' ' 205' ' ' GLU . 1.4 m0 -70.46 124.28 23.82 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.724 0.773 . . . . 0.34 111.02 -177.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 210' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -83.14 138.8 33.51 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.39 -1.277 . . . . 2.84 109.511 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 13.4 m -134.99 155.12 37.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.788 -0.642 . . . . 0.37 109.415 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -135.16 132.86 38.51 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.013 0.435 . . . . 0.98 110.707 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -87.81 153.75 21.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.687 -0.688 . . . . 1.21 110.492 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' LYS . . . . . 0.506 ' CD ' ' H ' ' A' ' 214' ' ' LYS . 2.1 mptp? -60.93 -8.28 3.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.761 -0.654 . . . . 1.69 110.164 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -92.6 -1.23 57.06 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.041 -0.527 . . . . 1.14 111.18 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' GLY . . . . . . . . . . . . . . . 89.61 14.26 60.07 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 121.199 -0.524 . . . . 0.45 112.075 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 -95.7 133.44 39.79 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.536 -0.542 . . . . 1.43 109.536 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -131.17 150.94 51.93 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.09 0.472 . . . . 1.81 111.266 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 178.78 174.83 45.33 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 110.641 -0.983 . . . . 0.29 110.641 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -76.48 152.24 36.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.835 0.35 . . . . 1.32 110.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -146.32 122.28 5.66 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.055 -0.52 . . . . 0.27 110.802 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -50.99 123.1 11.11 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 121.068 1.179 . . . . 0.33 110.83 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 223' ' ' SER . . . . . . . . . . . . . 78.3 p -70.88 -20.09 62.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.38 -0.528 . . . . 0.99 110.674 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 46.2 m -72.65 -31.89 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.814 -0.63 . . . . 1.36 111.943 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 225' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -88.95 16.79 6.45 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.033 0.383 . . . . 1.27 112.033 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 3.0 pp -145.05 -177.05 5.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.822 0.344 . . . . 0.2 110.09 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.75 149.89 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.114 -0.494 . . . . 1.21 109.764 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 228' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.27 124.59 24.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.237 -0.438 . . . . 1.42 111.72 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 229' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 230' ' ' SER . 86.8 tttt -81.05 -38.98 26.48 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.987 -0.745 . . . . 1.48 108.987 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 230' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 229' ' ' LYS . 8.3 t 48.46 106.35 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.466 0 CA-C-N 115.43 -0.805 . . . . 1.46 110.811 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 231' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.2 139.95 52.04 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.139 1.085 . . . . 2.68 110.735 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 232' ' ' ASN . . . . . . . . . . . . . 33.2 p-10 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 117.824 -1.084 . . . . 4.41 110.906 -178.806 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.256 -1.538 . . . . 4.56 109.256 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' SER . . . . . . . . . . . . . 3.2 m 177.72 59.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.482 0 CA-C-O 120.987 0.423 . . . . 4.08 110.393 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . 0.802 ' O ' ' N ' ' A' ' 173' ' ' GLU . 74.5 Cg_endo -74.44 112.66 3.6 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 122.106 1.871 . . . . 2.37 109.137 178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 171' ' ' PRO . 43.3 mt-10 12.47 -58.51 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 O-C-N 124.936 1.398 . . . . 2.91 113.267 -178.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' GLU . . . . . 0.802 ' N ' ' O ' ' A' ' 171' ' ' PRO . 40.4 mt-10 -66.66 147.64 52.99 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.71 -0.478 . . . . 1.78 109.71 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 3.4 t -162.42 -170.98 2.61 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.864 -0.334 . . . . 0.6 110.393 179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 1.2 mt -116.47 153.39 32.21 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.07 0.462 . . . . 0.87 110.91 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 15.3 m -131.41 159.1 43.29 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.391 0 CA-C-N 115.647 -0.706 . . . . 0.23 109.602 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . . . . . . . . . 69.6 mt -123.97 128.07 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 108.952 -0.758 . . . . 0.31 108.952 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' ALA . . . . . . . . . . . . . . . -80.26 114.58 19.27 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.939 0.399 . . . . 0.19 110.18 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.46 -42.32 98.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.963 -0.562 . . . . 0.31 111.326 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -121.04 155.05 35.22 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.292 0.568 . . . . 1.36 111.719 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -73.64 97.3 2.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.41 -0.814 . . . . 2.3 110.155 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -104.54 111.87 24.71 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.188 0.518 . . . . 1.46 111.229 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.548 ' NE2' ' H ' ' A' ' 184' ' ' THR . 36.2 tp60 -98.03 140.25 32.63 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.362 -0.836 . . . . 2.87 109.337 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . 0.836 HG23 ' H ' ' A' ' 186' ' ' ASP . 0.4 OUTLIER -117.91 172.07 7.64 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 121.05 0.452 . . . . 2.52 111.613 -178.202 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' ASN . . . . . 0.473 ' N ' HG23 ' A' ' 184' ' ' THR . 62.7 m-20 -130.21 19.73 5.36 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.433 -0.348 . . . . 3.85 111.477 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ASP . . . . . 0.836 ' H ' HG23 ' A' ' 184' ' ' THR . 7.2 m-20 -136.91 150.31 69.32 Favored Pre-proline 0 N--CA 1.472 0.638 0 O-C-N 122.483 -0.136 . . . . 2.47 110.806 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -72.6 -6.12 18.44 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 122.618 2.212 . . . . 1.93 111.547 178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -83.95 -35.54 23.91 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.228 -0.442 . . . . 2.61 110.082 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' GLU . . . . . 0.471 ' CB ' HG21 ' A' ' 184' ' ' THR . 0.6 OUTLIER -93.36 151.79 19.54 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.617 -0.883 . . . . 3.13 108.617 178.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' LEU . . . . . . . . . . . . . 26.2 tp -106.62 129.89 54.46 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 110.065 -0.346 . . . . 0.99 110.065 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . . . . -61.34 132.26 52.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.358 -0.608 . . . . 0.49 109.358 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' LEU . . . . . . . . . . . . . 41.5 mt -116.36 148.56 40.49 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.278 -0.419 . . . . 0.38 110.444 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.38 145.84 48.45 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.757 -0.46 . . . . 2.93 109.757 179.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' CYS . . . . . 0.432 ' O ' ' CB ' ' A' ' 195' ' ' ASP . 4.2 t -65.31 133.08 50.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.052 -0.522 . . . . 1.3 110.136 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 194' ' ' CYS . 1.2 t0 80.51 -15.46 0.74 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.933 -0.576 . . . . 1.95 111.034 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' GLU . . . . . . . . . . . . . 45.5 tp10 -81.35 156.35 25.52 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 109.971 -0.381 . . . . 2.01 109.971 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -123.72 166.89 14.78 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.096 -0.502 . . . . 1.27 111.103 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -144.42 167.03 23.45 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.243 0.544 . . . . 1.24 111.796 -179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.56 121.66 28.58 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.269 -0.878 . . . . 1.3 109.227 178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' LEU . . . . . . . . . . . . . 21.0 tp -87.47 128.28 35.23 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.702 0.287 . . . . 1.13 110.308 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' LEU . . . . . . . . . . . . . 5.0 mp -104.81 -62.15 1.37 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.59 111.646 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -102.63 103.83 14.15 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.605 0.24 . . . . 1.88 111.189 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 6.1 p -106.57 -19.03 13.79 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.894 0.702 . . . . 1.28 112.894 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' SER . . . . . 0.496 ' O ' ' O ' ' A' ' 205' ' ' GLU . 9.4 t -64.07 -24.53 67.74 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.912 0.863 . . . . 2.4 110.876 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' GLU . . . . . 0.718 ' CG ' ' N ' ' A' ' 206' ' ' ILE . 29.4 tt0 -19.01 171.22 0.0 OUTLIER 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 118.979 2.955 . . . . 5.9 118.979 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ILE . . . . . 0.718 ' N ' ' CG ' ' A' ' 205' ' ' GLU . 13.3 mm -147.53 -26.24 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 110.482 -3.054 . . . . 3.3 106.441 177.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' HIS . . . . . 0.552 ' H ' ' HG3' ' A' ' 205' ' ' GLU . 3.9 m-70 -100.27 -88.41 0.35 Allowed 'General case' 0 CA--C 1.56 1.335 0 N-CA-C 115.217 1.562 . . . . 2.19 115.217 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' TRP . . . . . 0.591 ' C ' ' OE1' ' A' ' 205' ' ' GLU . 90.6 m95 -128.4 120.06 26.2 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 113.34 0.867 . . . . 0.78 113.34 -175.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' TRP . . . . . 0.42 ' N ' ' OE2' ' A' ' 205' ' ' GLU . 1.4 m0 -70.46 124.28 23.82 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.724 0.773 . . . . 0.34 111.02 -177.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -83.14 138.8 33.51 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.39 -1.277 . . . . 2.84 109.511 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 13.4 m -134.99 155.12 37.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.788 -0.642 . . . . 0.37 109.415 179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -135.16 132.86 38.51 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.013 0.435 . . . . 0.98 110.707 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -87.81 153.75 21.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.687 -0.688 . . . . 1.21 110.492 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . 0.506 ' CD ' ' H ' ' A' ' 214' ' ' LYS . 2.1 mptp? -60.93 -8.28 3.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.761 -0.654 . . . . 1.69 110.164 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -92.6 -1.23 57.06 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.041 -0.527 . . . . 1.14 111.18 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' GLY . . . . . . . . . . . . . . . 89.61 14.26 60.07 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 121.199 -0.524 . . . . 0.45 112.075 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 -95.7 133.44 39.79 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.536 -0.542 . . . . 1.43 109.536 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -131.17 150.94 51.93 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.09 0.472 . . . . 1.81 111.266 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' GLY . . . . . . . . . . . . . . . 178.78 174.83 45.33 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 110.641 -0.983 . . . . 0.29 110.641 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -76.48 152.24 36.19 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.835 0.35 . . . . 1.32 110.374 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 221' ' ' ALA . . . . . . . . . . . . . . . -146.32 122.28 5.66 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.055 -0.52 . . . . 0.27 110.802 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 222' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -50.99 123.1 11.11 Favored 'Trans proline' 0 N--CA 1.489 1.248 0 C-N-CA 121.068 1.179 . . . . 0.33 110.83 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 223' ' ' SER . . . . . . . . . . . . . 78.3 p -70.88 -20.09 62.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 120.38 -0.528 . . . . 0.99 110.674 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 224' ' ' SER . . . . . . . . . . . . . 46.2 m -72.65 -31.89 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.814 -0.63 . . . . 1.36 111.943 -179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 225' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -88.95 16.79 6.45 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.033 0.383 . . . . 1.27 112.033 -177.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 226' ' ' LEU . . . . . . . . . . . . . 3.0 pp -145.05 -177.05 5.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.822 0.344 . . . . 0.2 110.09 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 227' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -149.75 149.89 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.114 -0.494 . . . . 1.21 109.764 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 228' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -69.27 124.59 24.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.237 -0.438 . . . . 1.42 111.72 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 229' ' ' LYS . . . . . 0.47 ' O ' ' O ' ' A' ' 230' ' ' SER . 86.8 tttt -81.05 -38.98 26.48 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.987 -0.745 . . . . 1.48 108.987 178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 230' ' ' SER . . . . . 0.47 ' O ' ' O ' ' A' ' 229' ' ' LYS . 8.3 t 48.46 106.35 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.466 0 CA-C-N 115.43 -0.805 . . . . 1.46 110.811 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 231' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.2 139.95 52.04 Favored 'Trans proline' 0 N--CA 1.492 1.404 0 CA-C-N 120.139 1.085 . . . . 2.68 110.735 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 232' ' ' ASN . . . . . . . . . . . . . 33.2 p-10 . . . . . 0 C--O 1.219 -0.533 0 CA-C-O 117.824 -1.084 . . . . 4.41 110.906 -178.806 . . . . . . . . 0 0 . 1 stop_ save_